Chemical Properties of Cyclopentanecarboxylic acid, 1-methyl- (CAS 5217-05-0)

InChI

InChI=1S/C7H12O2/c1-7(6(8)9)4-2-3-5-7/h2-5H2,1H3,(H,8,9)

InChI Key

MNIBBVOEXUQHFF-UHFFFAOYSA-N

Formula

C7H12O2

SMILES

CC1(C(=O)O)CCCC1

Molecular Weight¹

128.17

CAS

5217-05-0

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[130.45; 381.87]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-1.09350e+02
Coefficient B			1.14322e+00
Coefficient C			-1.08960e-03
Coefficient D			4.37600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	130.45	J/mol×K	273.00	Calculated Property
Cp,gas	178.10	J/mol×K	353.78	Calculated Property
Cp,gas	217.59	J/mol×K	434.56	Calculated Property
Cp,gas	250.31	J/mol×K	515.33	Calculated Property
Cp,gas	277.64	J/mol×K	596.11	Calculated Property
Cp,gas	300.97	J/mol×K	676.89	Calculated Property
Cp,gas	321.67	J/mol×K	757.67	Calculated Property
Cp,gas	341.13	J/mol×K	838.44	Calculated Property
Cp,gas	360.73	J/mol×K	919.22	Calculated Property
Cp,gas	381.87	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Cyclopentanecarboxylic acid, 1-methyl-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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